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Steroids

Antcin B

R/S-樟芝酸B

PHY-NP-11107 · Natural product research catalog

Catalog numberPHY-NP-11107
CAS number163597-25-9
Molecular formulaC29H40O5
Molecular weight468.634 g/mol
Chemical classSteroids
Main reported sourceTaiwanofungus camphoratus
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of Antcin B

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Product information

Antcin B is listed in the Steroids section of the Phytide Bio research catalog. Standard pack sizes are 5, 10, 20, 50 and 100 mg.

For research use only. Not for human or veterinary use, diagnosis or treatment.

Names & identifiers

IUPAC name2-methyl-3-methylidene-6-[(4S)-4,10,13-trimethyl-3,7,11-trioxo-1,2,4,5,6,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]heptanoic acid
SMILESC[C@H]1[C@@H]2CC(=O)C3=C([C@]2(CCC1=O)C)C(=O)C[C@]4([C@H]3CC[C@@H]4[C@H](C)CCC(=C)C(C)C(=O)O)C
InChIKeyDVORYMAGXQGBQK-QCMFUGJUSA-N
Subclass / scaffoldErgostane steroids
PubChem CID387397

Computed properties

Exact mass (Da)468.2876Predicted LogP5.5758
Predicted TPSA (Ų)88.51H-bond donors1
H-bond acceptors4Rotatable bonds6

Calculated values from the supplied dataset; not measured batch specifications.

View additional properties & classification
Ring count4
Aromatic rings0
Fraction Csp³0.724
Synthetic accessibility score4.94
QED score0.514
Lipinski rule violations1
NPClassifier pathwayTerpenoids
NPClassifier superclassSteroids
NPClassifier classErgostane steroids
Parent SMILESC=C(CC[C@@H](C)[C@H]1CC[C@H]2C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)[C@@H](C)[C@@H]1CC3=O)C(C)C(=O)O
Parent formulaC29H40O5
Parent molecular weight468.634
Specified stereocenters7
Unspecified stereocenters1

Reported natural occurrence

Main reported sourceTaiwanofungus camphoratus
Reported source familiesTaiwanofungaceae; Fomitopsidaceae

Reported natural occurrence does not establish the manufacturing origin of the supplied material.

View occurrence records & references
LOTUS / Wikidata speciesTaiwanofungus camphoratus[4]; Antrodia cinnamomea[1]
All reported source familiesTaiwanofungaceae[1]; Fomitopsidaceae[1]
LOTUS species records2
LOTUS reference records4
COCONUT occurrence recordsAntrodia cinnamomea; Taiwanofungus camphoratus
COCONUT organism records2
COCONUT identifierCNP0174168.2

Records are inherited from the supplied dataset and are not independently verified. Taxonomic names may include synonyms.

Documents & specifications

Certificate of analysis (COA)Batch-specific COA available on request; no PDF published yet
Safety data sheet (SDS)Not yet published
Storage / solubilityProduct-specific conditions to be confirmed
ShippingConfirmed with the quotation

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